2-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-benzonitrile CAS Name: 2-[4-(2-ethoxyphenyl)-1-piperazinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitrobenzonitrile Traditional Name: 5-nitro-2-(4-o-phenetylpiperazino)benzonitrile Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H20N4O3/c1-2-26-19-6-4-3-5-18(19)22-11-9-21(10-12-22)17-8-7-16(23(24)25)13-15(17)14-20/h3-8,13H,2,9-12H2,1H3